4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=37.4322695782 stress="-28.67724965256487 2.594547515421181 2.8226350231326034 2.594547515421181 -22.510665603204124 6.0249800142661405 2.8226350231326034 6.0249800142661405 -36.323562280228465" pbc="F F F" U -0.25354363 -0.01806569 -0.07998135 -34.29964633 -29.76832798 -29.53309458 U 1.70070203 1.20342959 -0.09914834 46.99094482 44.47113260 -88.53139300 U 1.49793547 0.28187239 1.51001192 37.93821042 -63.85400860 86.23680030 U -0.01546661 1.60170120 1.37793365 -50.62950891 49.15120398 31.82768728